Geometry & MOs

Info

ID:	218294
PubChem CID:	85089138
Reduced:	N3O4C25H39 (1)
Stoich.:	A3B4C25D39 (1)
Weight, g/mol:	445.097538
ΔH_f, kcal/mol:	-209.75
Dipole, Da:	7.89
IP(EA), eV:	-9.55(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[[5-chloro-1-(4-methoxyphenyl)sulfonylindol-3-yl]-cyclopropylmethylidene]amino]guanidine

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC1CCCCC1)NC(=O)C(CCC2=CC=CC=C2)NC(C)C(=O)O

DOS

IR

Vibrations